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4-(1,2,4-oxadiazol-3-yl)-1,2,5-oxadiazol-3-amine

HCID 1244573
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Basic information

CAS
163011-56-1
Standard SMILES
Nc1nonc1-c1ncon1
InChIKey
XHCUQOVMSNRPKS-UHFFFAOYSA-N
Molecular formula
C4H3N5O2
Average molar mass
153.101 g/mol
Monoisotopic mass
153.02867434

Names & identifiers

Preferred name
4-(1,2,4-oxadiazol-3-yl)-1,2,5-oxadiazol-3-amine
IUPAC
4-(1,2,4-Oxadiazol-3-yl)-1,2,5-oxadiazol-3-amine
English name
4-(1,2,4-Oxadiazol-3-yl)-1,2,5-oxadiazol-3-amine
Molecular formula
C4H3N5O2
Molecular weight
153.1

Names & synonyms

AKOS JY2090335TIMTEC-BB SBB006791CHEMBRDG-BB 40098494-[1,2,4]OXADIAZOL-3-YL-FURAZAN-3-YLAMINE4-(1,2,4-Oxadiazol-3-yl)-1,2,5-oxadiazol-3-amine1,2,5-Oxadiazol-3-amine, 4-(1,2,4-oxadiazol-3-yl)-4-(1,2,4-oxadiazol-3-yl)-1,2,5-oxadiazol-3-amine(SALTDATA: FREE)

Database identifiers

CAS
163011-56-1
PubChem CID
1244573
DTXSID
DTXSID80361343
EC Number
846-300-2

Properties

Physicochemical properties

Boiling point
371.8 · 371.8±52.0 °C(Predicted)
Density
1.603 · 1.603±0.06 g/cm3(Predicted)
pka
-2.29 · -2.29±0.47(Predicted)
form
solid
InChI
1S/C4H3N5O2/c5-3-2(7-11-8-3)4-6-1-10-9-4/h1H,(H2,5,8)
InChIKey
XHCUQOVMSNRPKS-UHFFFAOYSA-N
SMILES
NC1=NON=C1C2=NOC=N2
UNSPSC Code
12352116 · 12352116
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302
Precautionary statements
301 · P301+P312+P330
Hazard Codes
Xn
Risk Statements
22 · 22
WGK Germany
3 · WGK 3
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
4 Oral · Acute Tox. 4 Oral

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

wgk
WGK 3
risk_code
22
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xn
Storage Class
11 - Combustible Solids
Hazard statements
H302
Hazard Classifications
Acute Tox. 4 Oral
Precautionary statements
P301+P312+P330

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